SCHEMBL17877602

SCHEMBL17877602

N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)-c1cc(-c3cc(-c4cccnc4)cc(-c4cccnc4)c3)ccc1OCO2

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 10/20 0.42
CYP11B1 P15538 7/20 0.42
CYP17A1 P05093 1/20 0.42
FLT3 P36888 2/20 0.41
EDNRB P24530 1/20 0.38
EDNRA P25101 1/20 0.38
USP2 O75604 1/20 0.36
CYP19A1 P11511 1/20 0.35
TDP2 O95551 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PTGER4 P35408 1/20 0.34
CHRNB2 P17787 1/20 0.34
CHRNA5 P30532 1/20 0.34
CHRNA4 P43681 1/20 0.34
FYN P06241 1/20 0.34

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17876023 0.96 FLT3 (0.41) CYP11B2CYP11B1CYP17A1FLT3EDNRB
SCHEMBL17877866 0.96 CYP11B2 (0.40) CYP11B2CYP11B1CYP17A1FLT3EDNRB
SCHEMBL17876114 0.90 EDNRA (0.39) CYP11B2CYP11B1FLT3EDNRBEDNRA
SCHEMBL17877604 0.90 EDNRA (0.44) EDNRBEDNRAUSP2TDP2ALDH1A1
SCHEMBL17876085 0.90 CYP11B1 (0.44) CYP11B2CYP11B1CYP17A1EDNRBEDNRA
SCHEMBL17877830 0.88 CYP11B2 (0.41) CYP11B2CYP11B1CYP17A1FLT3CYP19A1
SCHEMBL17877778 0.87 CYP11B2 (0.43) CYP11B2CYP11B1CYP17A1FLT3CYP19A1
SCHEMBL17877603 0.86 ALDH1A1 (0.42) FLT3EDNRBEDNRAUSP2TDP2
SCHEMBL17877813 0.85 EDNRA (0.44) EDNRBEDNRAUSP2TDP2ALDH1A1
SCHEMBL17876059 0.85 CYP11B1 (0.44) CYP11B2CYP11B1EDNRBEDNRAALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10581000-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2020-03-03 US disclosed
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2016-06-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10581000-B2 Condensed cyclic compound and organic light-emitting device including the same CRY1, CRY2, CCNE2 CYP11B2 1374/4885CYP11B1 938/4885CYP17A1 909/4885
US-20160190482-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CRY2, CCNE2 CYP11B2 1374/4885CYP11B1 938/4885CYP17A1 909/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.